- InChI
- InChI=1S/C13H15ClO4/c1-3-17-12(15)10-6-4-5-7-11(10)13(16)18-8-9(2)14/h4-7,9H,3,8H2,1-2H3
- InChI Key
- YFHRWQJTTKJKPE-UHFFFAOYSA-N
- Formula
- C13H15ClO4
- SMILES
- CCOC(=O)c1ccccc1C(=O)OCC(C)Cl
- Molecular Weight1
- 270.71
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -320.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -597.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.78 | kJ/mol | Joback Calculated Property |
| log10WS | -3.48 | Crippen Calculated Property | |
| logPoct/wat | 2.647 | Crippen Calculated Property | |
| McVol | 197.390 | ml/mol | McGowan Calculated Property |
| Pc | 2295.91 | kPa | Joback Calculated Property |
| Inp | 1868.00 | NIST | |
| Tboil | 718.07 | K | Joback Calculated Property |
| Tc | 933.75 | K | Joback Calculated Property |
| Tfus | 434.45 | K | Joback Calculated Property |
| Vc | 0.747 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [513.64; 578.75] | J/mol×K | [718.07; 933.75] | 
|
| Cp,gas | 513.64 | J/mol×K | 718.07 | Joback Calculated Property |
| Cp,gas | 526.77 | J/mol×K | 754.02 | Joback Calculated Property |
| Cp,gas | 538.97 | J/mol×K | 789.96 | Joback Calculated Property |
| Cp,gas | 550.27 | J/mol×K | 825.91 | Joback Calculated Property |
| Cp,gas | 560.66 | J/mol×K | 861.85 | Joback Calculated Property |
| Cp,gas | 570.15 | J/mol×K | 897.80 | Joback Calculated Property |
| Cp,gas | 578.75 | J/mol×K | 933.75 | Joback Calculated Property |
| η | [0.0001127; 0.0010572] | Pa×s | [434.45; 718.07] |
|
| η | 0.0010572 | Pa×s | 434.45 | Joback Calculated Property |
| η | 0.0006062 | Pa×s | 481.72 | Joback Calculated Property |
| η | 0.0003839 | Pa×s | 528.99 | Joback Calculated Property |
| η | 0.0002621 | Pa×s | 576.26 | Joback Calculated Property |
| η | 0.0001896 | Pa×s | 623.53 | Joback Calculated Property |
| η | 0.0001435 | Pa×s | 670.80 | Joback Calculated Property |
| η | 0.0001127 | Pa×s | 718.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2-chloropropyl ethyl ester.
Sources
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